N-[3-(2-methyl-1,3-thiazol-4-yl)phenyl]-4-(1H-1,2,4-triazol-5-ylsulfanylmethyl)benzamide

Systemtic Name: N-[3-(2-methyl-1,3-thiazol-4-yl)phenyl]-4-(1H-1,2,4-triazol-5-ylsulfanylmethyl)benzamide Openeye Name: N-[3-(2-methylthiazol-4-yl)phenyl]-4-(1H-1,2,4-triazol-5-ylsulfanylmethyl)benzamide CAS Name: N-[3-(2-methyl-4-thiazolyl)phenyl]-4-[(1H-1,2,4-triazol-5-ylthio)methyl]benzamide IUPAC Name: N-[3-(2-methyl-1,3-thiazol-4-yl)phenyl]-4-(1H-1,2,4-triazol-5-ylsulfanylmethyl)benzamide Traditional Name: N-[3-(2-methylthiazol-4-yl)phenyl]-4-[(1H-1,2,4-triazol-5-ylthio)methyl]benzamide Formula: C20H17N5OS2 MolecularWeight: 407.51188

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CS1)C2=CC(=CC=C2)NC(=O)C3=CC=C(C=C3)CSC4=NC=NN4

Isomeric SMILES

CC1=NC(=CS1)C2=CC(=CC=C2)NC(=O)C3=CC=C(C=C3)CSC4=NC=NN4

InChI

InChI=1S/C20H17N5OS2/c1-13-23-18(11-27-13)16-3-2-4-17(9-16)24-19(26)15-7-5-14(6-8-15)10-28-20-21-12-22-25-20/h2-9,11-12H,10H2,1H3,(H,24,26)(H,21,22,25)